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Compile Data Set for Download or QSAR

Found 46 hits Enz. Inhib. hit(s) with all data for entry = 6415   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127911
PNG
(US8791130, 41)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-c2cnn(C)c2C(=O)N(C)C)ncc1C(F)(F)F
Show InChI InChI=1S/C20H21F4N7O2/c1-25-17-12(20(22,23)24)9-26-19(29-17)28-14-7-13(21)10(6-15(14)33-5)11-8-27-31(4)16(11)18(32)30(2)3/h6-9H,1-5H3,(H2,25,26,28,29)
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1n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127895
PNG
(US8791130, 25)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2ccnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C17H17F3N6O/c1-21-15-11(17(18,19)20)9-22-16(25-15)24-12-5-4-10(8-14(12)27-3)13-6-7-23-26(13)2/h4-9H,1-3H3,(H2,21,22,24,25)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127896
PNG
(US8791130, 26)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2c(C)noc2C)ncc1C(F)(F)F
Show InChI InChI=1S/C18H18F3N5O2/c1-9-15(10(2)28-26-9)11-5-6-13(14(7-11)27-4)24-17-23-8-12(18(19,20)21)16(22-3)25-17/h5-8H,1-4H3,(H2,22,23,24,25)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127915
PNG
(US8791130, 45)
Show SMILES CNc1nc(Nc2cc(C)c(cc2OC)-n2nnnc2C)ncc1C(F)(F)F
Show InChI InChI=1S/C16H17F3N8O/c1-8-5-11(13(28-4)6-12(8)27-9(2)24-25-26-27)22-15-21-7-10(16(17,18)19)14(20-3)23-15/h5-7H,1-4H3,(H2,20,21,22,23)
PDB

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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127916
PNG
(US8791130, 46)
Show SMILES CNc1nc(Nc2cc(C)c(cc2OC)-n2nnnc2COC)ncc1C(F)(F)F
Show InChI InChI=1S/C17H19F3N8O2/c1-9-5-11(23-16-22-7-10(17(18,19)20)15(21-2)24-16)13(30-4)6-12(9)28-14(8-29-3)25-26-27-28/h5-7H,8H2,1-4H3,(H2,21,22,23,24)
PDB

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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127908
PNG
(US8791130, 38)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cn(C)nc2C)ncc1C(F)(F)F
Show InChI InChI=1S/C18H19F3N6O/c1-10-12(9-27(3)26-10)11-5-6-14(15(7-11)28-4)24-17-23-8-13(18(19,20)21)16(22-2)25-17/h5-9H,1-4H3,(H2,22,23,24,25)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127905
PNG
(US8791130, 35)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cnn(C)c2)ncc1Cl
Show InChI InChI=1S/C16H17ClN6O/c1-18-15-12(17)8-19-16(22-15)21-13-5-4-10(6-14(13)24-3)11-7-20-23(2)9-11/h4-9H,1-3H3,(H2,18,19,21,22)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127878
PNG
(US8791130, 8)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cncn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C17H17F3N6O/c1-21-15-11(17(18,19)20)7-23-16(25-15)24-12-5-4-10(6-14(12)27-3)13-8-22-9-26(13)2/h4-9H,1-3H3,(H2,21,23,24,25)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127913
PNG
(US8791130, 43)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-c2cnnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C16H15F4N7O/c1-21-14-9(16(18,19)20)6-22-15(25-14)24-11-5-10(17)8(4-13(11)28-3)12-7-23-26-27(12)2/h4-7H,1-3H3,(H2,21,22,24,25)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127897
PNG
(US8791130, 27)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-n2cnnn2)ncc1C(F)(F)F
Show InChI InChI=1S/C14H13F3N8O/c1-18-12-9(14(15,16)17)6-19-13(22-12)21-10-4-3-8(5-11(10)26-2)25-7-20-23-24-25/h3-7H,1-2H3,(H2,18,19,21,22)
PDB

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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127887
PNG
(US8791130, 17)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cnnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C16H16F3N7O/c1-20-14-10(16(17,18)19)7-21-15(24-14)23-11-5-4-9(6-13(11)27-3)12-8-22-25-26(12)2/h4-8H,1-3H3,(H2,20,21,23,24)
PDB

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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127886
PNG
(US8791130, 16)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cncn2C)ncc1Cl
Show InChI InChI=1S/C16H17ClN6O/c1-18-15-11(17)7-20-16(22-15)21-12-5-4-10(6-14(12)24-3)13-8-19-9-23(13)2/h4-9H,1-3H3,(H2,18,20,21,22)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127910
PNG
(US8791130, 40)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2nncn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C16H16F3N7O/c1-20-13-10(16(17,18)19)7-21-15(24-13)23-11-5-4-9(6-12(11)27-3)14-25-22-8-26(14)2/h4-8H,1-3H3,(H2,20,21,23,24)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127891
PNG
(US8791130, 21)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2cncn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C17H16ClF3N6O/c1-22-15-10(17(19,20)21)6-24-16(26-15)25-12-5-14(28-3)9(4-11(12)18)13-7-23-8-27(13)2/h4-8H,1-3H3,(H2,22,24,25,26)
PDB

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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127909
PNG
(US8791130, 39)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cnn(C)c2C)ncc1C(F)(F)F
Show InChI InChI=1S/C18H19F3N6O/c1-10-12(8-24-27(10)3)11-5-6-14(15(7-11)28-4)25-17-23-9-13(18(19,20)21)16(22-2)26-17/h5-9H,1-4H3,(H2,22,23,25,26)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127889
PNG
(US8791130, 19)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2nccn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C17H16ClF3N6O/c1-22-14-10(17(19,20)21)8-24-16(26-14)25-12-7-13(28-3)9(6-11(12)18)15-23-4-5-27(15)2/h4-8H,1-3H3,(H2,22,24,25,26)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127890
PNG
(US8791130, 20)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2nnnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C15H15F3N8O/c1-19-12-9(15(16,17)18)7-20-14(22-12)21-10-5-4-8(6-11(10)27-3)13-23-24-25-26(13)2/h4-7H,1-3H3,(H2,19,20,21,22)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127912
PNG
(US8791130, 42)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-n2nnnc2C)ncc1C(F)(F)F
Show InChI InChI=1S/C15H14F4N8O/c1-7-24-25-26-27(7)11-5-12(28-3)10(4-9(11)16)22-14-21-6-8(15(17,18)19)13(20-2)23-14/h4-6H,1-3H3,(H2,20,21,22,23)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127872
PNG
(US8791130, 1)
Show SMILES CNc1nc(Nc2ccc(cc2Cl)-c2nnn[nH]2)ncc1C(F)(F)F
Show InChI InChI=1S/C13H10ClF3N8/c1-18-11-7(13(15,16)17)5-19-12(21-11)20-9-3-2-6(4-8(9)14)10-22-24-25-23-10/h2-5H,1H3,(H2,18,19,20,21)(H,22,23,24,25)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127894
PNG
(US8791130, 24)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2c(C)nn(C)c2C)ncc1C(F)(F)F |(-1.75,2.87,;-3.08,2.1,;-3.08,.56,;-1.75,-.21,;-1.75,-1.75,;-.41,-2.52,;.92,-1.75,;.92,-.21,;2.25,.56,;2.25,2.1,;.92,2.87,;3.59,-.21,;3.59,-1.75,;2.25,-2.52,;2.25,-4.06,;4.92,.56,;6.38,.08,;6.78,-1.41,;7.29,1.33,;6.38,2.57,;6.78,4.06,;4.92,2.1,;3.59,2.87,;-3.08,-2.52,;-4.42,-1.75,;-4.42,-.21,;-5.75,.56,;-7.29,.56,;-5.75,2.1,;-6.52,-.78,)|
Show InChI InChI=1S/C19H20ClF3N6O/c1-9-16(10(2)29(4)28-9)11-6-13(20)14(7-15(11)30-5)26-18-25-8-12(19(21,22)23)17(24-3)27-18/h6-8H,1-5H3,(H2,24,25,26,27)
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Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127893
PNG
(US8791130, 23)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cnnn2C)ncc1Cl
Show InChI InChI=1S/C15H16ClN7O/c1-17-14-10(16)7-18-15(21-14)20-11-5-4-9(6-13(11)24-3)12-8-19-22-23(12)2/h4-8H,1-3H3,(H2,17,18,20,21)
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3n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127874
PNG
(US8791130, 4)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-n2cncn2)ncc1C(F)(F)F
Show InChI InChI=1S/C15H14F3N7O/c1-19-13-10(15(16,17)18)6-21-14(24-13)23-11-4-3-9(5-12(11)26-2)25-8-20-7-22-25/h3-8H,1-2H3,(H2,19,21,23,24)
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3n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127881
PNG
(US8791130, 11)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2cnnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C16H15ClF3N7O/c1-21-14-9(16(18,19)20)6-22-15(25-14)24-11-5-13(28-3)8(4-10(11)17)12-7-23-26-27(12)2/h4-7H,1-3H3,(H2,21,22,24,25)
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4n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127875
PNG
(US8791130, 5)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cnn(C)c2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H17F3N6O/c1-21-15-12(17(18,19)20)8-22-16(25-15)24-13-5-4-10(6-14(13)27-3)11-7-23-26(2)9-11/h4-9H,1-3H3,(H2,21,22,24,25)
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4n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127919
PNG
(US8791130, 49)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-n2nnnc2COC)ncc1C(F)(F)F
Show InChI InChI=1S/C16H16F4N8O2/c1-21-14-8(16(18,19)20)6-22-15(24-14)23-10-4-9(17)11(5-12(10)30-3)28-13(7-29-2)25-26-27-28/h4-6H,7H2,1-3H3,(H2,21,22,23,24)
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4n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127917
PNG
(US8791130, 47)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-n2nc(C)cc2COC)ncc1C(F)(F)F
Show InChI InChI=1S/C19H20F4N6O2/c1-10-5-11(9-30-3)29(28-10)15-7-16(31-4)14(6-13(15)20)26-18-25-8-12(19(21,22)23)17(24-2)27-18/h5-8H,9H2,1-4H3,(H2,24,25,26,27)
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5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127898
PNG
(US8791130, 28)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2ccnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C17H16ClF3N6O/c1-22-15-10(17(19,20)21)8-23-16(26-15)25-12-7-14(28-3)9(6-11(12)18)13-4-5-24-27(13)2/h4-8H,1-3H3,(H2,22,23,25,26)
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5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127885
PNG
(US8791130, 15)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2nccn2C)ncc1Cl
Show InChI InChI=1S/C16H17ClN6O/c1-18-14-11(17)9-20-16(22-14)21-12-5-4-10(8-13(12)24-3)15-19-6-7-23(15)2/h4-9H,1-3H3,(H2,18,20,21,22)
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7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50398666
PNG
(CHEMBL2178136 | US8791130, 2)
Show SMILES CNc1nc(Nc2ccc(cc2Cl)-c2nnnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C14H12ClF3N8/c1-19-11-8(14(16,17)18)6-20-13(22-11)21-10-4-3-7(5-9(10)15)12-23-24-25-26(12)2/h3-6H,1-2H3,(H2,19,20,21,22)
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7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127880
PNG
(US8791130, 10)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2nnnn2C)ncc1Cl
Show InChI InChI=1S/C14H15ClN8O/c1-16-12-9(15)7-17-14(19-12)18-10-5-4-8(6-11(10)24-3)13-20-21-22-23(13)2/h4-7H,1-3H3,(H2,16,17,18,19)
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7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127899
PNG
(US8791130, 29)
Show SMILES CCNc1nc(Nc2cc(F)c(cc2OC)-c2nnc(C)o2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H16F4N6O2/c1-4-22-14-10(17(19,20)21)7-23-16(25-14)24-12-6-11(18)9(5-13(12)28-3)15-27-26-8(2)29-15/h5-7H,4H2,1-3H3,(H2,22,23,24,25)
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7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127877
PNG
(US8791130, 7)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2nnc(C)o2)ncc1C(F)(F)F
Show InChI InChI=1S/C16H14ClF3N6O2/c1-7-25-26-14(28-7)8-4-10(17)11(5-12(8)27-3)23-15-22-6-9(16(18,19)20)13(21-2)24-15/h4-6H,1-3H3,(H2,21,22,23,24)
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8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127918
PNG
(US8791130, 48)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-n2nc(C)cc2COC)ncc1C(F)(F)F
Show InChI InChI=1S/C19H21F3N6O2/c1-11-7-13(10-29-3)28(27-11)12-5-6-15(16(8-12)30-4)25-18-24-9-14(19(20,21)22)17(23-2)26-18/h5-9H,10H2,1-4H3,(H2,23,24,25,26)
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10n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127892
PNG
(US8791130, 22)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-c2nnnn2C)ncc1C(F)(F)F
Show InChI InChI=1S/C15H14F4N8O/c1-20-12-8(15(17,18)19)6-21-14(23-12)22-10-5-9(16)7(4-11(10)28-3)13-24-25-26-27(13)2/h4-6H,1-3H3,(H2,20,21,22,23)
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10n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127888
PNG
(US8791130, 18)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2nnn(C)n2)ncc1C(F)(F)F
Show InChI InChI=1S/C15H15F3N8O/c1-19-13-9(15(16,17)18)7-20-14(22-13)21-10-5-4-8(6-11(10)27-3)12-23-25-26(2)24-12/h4-7H,1-3H3,(H2,19,20,21,22)
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10n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127914
PNG
(US8791130, 44)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-c2cnn(c2)C2COC2)ncc1C(F)(F)F
Show InChI InChI=1S/C19H18F4N6O2/c1-24-17-13(19(21,22)23)6-25-18(28-17)27-15-4-14(20)12(3-16(15)30-2)10-5-26-29(7-10)11-8-31-9-11/h3-7,11H,8-9H2,1-2H3,(H2,24,25,27,28)
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10n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127902
PNG
(US8791130, 32)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2cnn(C)c2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H16ClF3N6O/c1-22-15-11(17(19,20)21)7-23-16(26-15)25-13-5-14(28-3)10(4-12(13)18)9-6-24-27(2)8-9/h4-8H,1-3H3,(H2,22,23,25,26)
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11n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127900
PNG
(US8791130, 30)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-c2nnc(C)o2)ncc1C(F)(F)F
Show InChI InChI=1S/C16H14F4N6O2/c1-7-25-26-14(28-7)8-4-12(27-3)11(5-10(8)17)23-15-22-6-9(16(18,19)20)13(21-2)24-15/h4-6H,1-3H3,(H2,21,22,23,24)
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12n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127907
PNG
(US8791130, 37)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2nnc(C)o2)ncc1Cl
Show InChI InChI=1S/C15H14Cl2N6O2/c1-7-22-23-14(25-7)8-4-9(16)11(5-12(8)24-3)20-15-19-6-10(17)13(18-2)21-15/h4-6H,1-3H3,(H2,18,19,20,21)
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12n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127884
PNG
(US8791130, 14)
Show SMILES CNc1nc(Nc2ccc(cc2OC)-c2cnoc2)ncc1Cl
Show InChI InChI=1S/C15H14ClN5O2/c1-17-14-11(16)7-18-15(21-14)20-12-4-3-9(5-13(12)22-2)10-6-19-23-8-10/h3-8H,1-2H3,(H2,17,18,20,21)
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15n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127873
PNG
(US8791130, 3)
Show SMILES CNc1nc(Nc2ccc(cc2Cl)-c2nnn(C)n2)ncc1C(F)(F)F
Show InChI InChI=1S/C14H12ClF3N8/c1-19-12-8(14(16,17)18)6-20-13(22-12)21-10-4-3-7(5-9(10)15)11-23-25-26(2)24-11/h3-6H,1-2H3,(H2,19,20,21,22)
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18n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127903
PNG
(US8791130, 33)
Show SMILES CNc1nc(Nc2ccc(cc2Cl)-c2nnc(C)o2)ncc1Cl
Show InChI InChI=1S/C14H12Cl2N6O/c1-7-21-22-13(23-7)8-3-4-11(9(15)5-8)19-14-18-6-10(16)12(17-2)20-14/h3-6H,1-2H3,(H2,17,18,19,20)
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30n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127876
PNG
(US8791130, 6)
Show SMILES CNc1nc(Nc2cc(F)c(cc2OC)-c2nc(C)no2)ncc1C(F)(F)F
Show InChI InChI=1S/C16H14F4N6O2/c1-7-23-14(28-26-7)8-4-12(27-3)11(5-10(8)17)24-15-22-6-9(16(18,19)20)13(21-2)25-15/h4-6H,1-3H3,(H2,21,22,24,25)
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UniProtKB/SwissProt

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US Patent
32n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127901
PNG
(US8791130, 31)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2nc(C)no2)ncc1C(F)(F)F
Show InChI InChI=1S/C16H14ClF3N6O2/c1-7-23-14(28-26-7)8-4-10(17)11(5-12(8)27-3)24-15-22-6-9(16(18,19)20)13(21-2)25-15/h4-6H,1-3H3,(H2,21,22,24,25)
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US Patent
41n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127906
PNG
(US8791130, 36)
Show SMILES CNc1nc(Nc2cc(OC)c(cc2Cl)-c2nc(C)no2)ncc1Cl
Show InChI InChI=1S/C15H14Cl2N6O2/c1-7-20-14(25-23-7)8-4-9(16)11(5-12(8)24-3)21-15-19-6-10(17)13(18-2)22-15/h4-6H,1-3H3,(H2,18,19,21,22)
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44n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM127904
PNG
(US8791130, 34)
Show SMILES CNc1nc(Nc2ccc(cc2Cl)-c2nc(C)no2)ncc1Cl
Show InChI InChI=1S/C14H12Cl2N6O/c1-7-19-13(23-22-7)8-3-4-11(9(15)5-8)20-14-18-6-10(16)12(17-2)21-14/h3-6H,1-2H3,(H2,17,18,20,21)
PDB

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UniProtKB/SwissProt

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antibodypedia
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US Patent
80n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8791130 (2014)


BindingDB Entry DOI: 10.7270/Q2K9367R
More data for this
Ligand-Target Pair